Identifier: MM97876
2D Structure
3D Structure
Source:
General | |
Identifier | MM97876 |
SMILES |
CNCC(N)CO
|
InChIKey |
JILLBSYVFXHBBT-UHFFFAOYSA-N
|
MW [Da] |
104.15
Automatically obtained from RDkit software. |
LogP |
-1.47
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM112577
Similarity: 0.7778
Similarity to MM112577
Tanimoto metric | 0.7778 |
---|---|
Cosine metric | 0.8819 |
Dice metric | 0.875 |
MW: | 118.18 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | -1.08 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM104178
Similarity: 0.75
Similarity to MM104178
Tanimoto metric | 0.75 |
---|---|
Cosine metric | 0.866 |
Dice metric | 0.8571 |
MW: | 118.18 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | -1.13 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM115918
Similarity: 0.7368
Similarity to MM115918
Tanimoto metric | 0.7368 |
---|---|
Cosine metric | 0.8584 |
Dice metric | 0.8485 |
MW: | 118.18 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | -1.21 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+537 more